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3-Methyl-2,4-pentanediol

3-Methyl-2,4-pentanediol structure

CAS No:
5683-44-3
Formula:
C6H14O2
Chemical Name:
3-Methyl-2,4-pentanediol
Synonyms:
2,4-Pentanediol,3-methyl-;3-Methyl-2,4-pentanediol;3-Methylpentanediol-2,4;NSC 66498
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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3-Methyl-2,4-pentanediol Basic Attributes

Molecular Weight：

118.17400

Exact Mass：

118.17

EC Number：

227-150-1

NSC Number：

66498

HScode：

2905399090

Characteristics

PSA：

40.46000

XLogP3：

0.53140

Density：

0.9325 g/cm³ @ Temp: 20 °C

Melting Point：

-40ºC(lit.)

Boiling Point：

211.5 °C

Flash Point：

91.3ºC

Refractive Index：

n20/D 1.427(lit.)

Storage Conditions：

2-8ºC

Vapor Pressure：

0.02 mm Hg ( 20 °C)

Safety Information

wgk germany：

hazard class code：

R36/38

safety instructions：

26-36

RTECS Number：

SA0810000

Marks：

Xi: Irritant;

Computed Properties

Molecular Weight:118.17
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:118.099379685
Monoisotopic Mass:118.099379685
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:55.5
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 3-Methyl-2,4-pentanediol

Guangzhou Yaoguang Technology Co., Ltd. Contact Supplier

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5 YRS

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5683-44-3

CAS No.: 5683-44-3

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